Crystallography Open Database

Information card for entry 4129896

Preview

Coordinates	4129896.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 H10 Br2 F6 Te
Calculated formula	C18 H10 Br2 F6 Te
Title of publication	A Mechanistic Study of Halogen Addition and Photoelimination from π-Conjugated Tellurophenes.
Authors of publication	Carrera, Elisa I.; Lanterna, Anabel E.; Lough, Alan J.; Scaiano, Juan C.; Seferos, Dwight S.
Journal of publication	Journal of the American Chemical Society
Year of publication	2016
Journal volume	138
Journal issue	8
Pages of publication	2678 - 2689
a	25.7637 ± 0.0016 Å
b	9.6107 ± 0.0006 Å
c	7.6918 ± 0.0005 Å
α	90°
β	94.119 ± 0.002°
γ	90°
Cell volume	1899.6 ± 0.2 Å³
Cell temperature	147 ± 2 K
Ambient diffraction temperature	147 ± 2 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0279
Residual factor for significantly intense reflections	0.0208
Weighted residual factors for significantly intense reflections	0.0467
Weighted residual factors for all reflections included in the refinement	0.0502
Goodness-of-fit parameter for all reflections included in the refinement	1.059
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4129896.html